(phenylmethyl) 2-[2-methyl-1-[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]phenyl]carbonyl-indol-3-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-methyl-1-[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]phenyl]carbonyl-indol-3-yl]ethanoate Openeye Name: benzyl 2-[2-methyl-1-[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]indol-3-yl]acetate CAS Name: 2-[2-methyl-1-[[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]phenyl]-oxomethyl]-3-indolyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-methyl-1-[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]indol-3-yl]acetate Traditional Name: 2-[2-methyl-1-[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]indol-3-yl]acetic acid benzyl ester Formula: C36H34N2O5 MolecularWeight: 574.66556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2C(=C(C3=CC=CC=C32)CC(=O)OCC4=CC=CC=C4)C)OCC5CN(C6=CC=CC=C6O5)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2C(=C(C3=CC=CC=C32)CC(=O)OCC4=CC=CC=C4)C)OC[C@@H]5CN(C6=CC=CC=C6O5)C

InChI

InChI=1S/C36H34N2O5/c1-24-19-27(17-18-33(24)41-23-28-21-37(3)32-15-9-10-16-34(32)43-28)36(40)38-25(2)30(29-13-7-8-14-31(29)38)20-35(39)42-22-26-11-5-4-6-12-26/h4-19,28H,20-23H2,1-3H3/t28-/m0/s1