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

Systemtic Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methylamino]phenyl]carbonyl-indol-3-yl]ethanoate Openeye Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methylamino]benzoyl]indol-3-yl]acetate CAS Name: 2-[2-methyl-1-[[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methylamino]phenyl]-oxomethyl]-3-indolyl]acetate IUPAC Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methylamino]benzoyl]indol-3-yl]acetate Traditional Name: 2-[2-methyl-1-[4-[(4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl)methylamino]benzoyl]indol-3-yl]acetate Formula: C28H26N3O4- MolecularWeight: 468.52374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)NCC4CN(C5=CC=CC=C5O4)C)CC(=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)NCC4CN(C5=CC=CC=C5O4)C)CC(=O)[O-]

InChI

InChI=1S/C28H27N3O4/c1-18-23(15-27(32)33)22-7-3-4-8-24(22)31(18)28(34)19-11-13-20(14-12-19)29-16-21-17-30(2)25-9-5-6-10-26(25)35-21/h3-14,21,29H,15-17H2,1-2H3,(H,32,33)/p-1