ethyl 2-[[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl-pentyl-carbamoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl-pentyl-carbamoyl]amino]ethanoate Openeye Name: ethyl 2-[[[1-(m-tolylmethyl)pyrrol-2-yl]methyl-pentyl-carbamoyl]amino]acetate CAS Name: 2-[[[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl-pentylamino]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl-pentylcarbamoyl]amino]acetate Traditional Name: 2-[[amyl-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]carbamoyl]amino]acetic acid ethyl ester Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=CC(=C2)C)C(=O)NCC(=O)OCC

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=CC(=C2)C)C(=O)NCC(=O)OCC

InChI

InChI=1S/C23H33N3O3/c1-4-6-7-13-26(23(28)24-16-22(27)29-5-2)18-21-12-9-14-25(21)17-20-11-8-10-19(3)15-20/h8-12,14-15H,4-7,13,16-18H2,1-3H3,(H,24,28)