N-[4-[[[3-(aminomethyl)phenyl]methyl-ethanoyl-amino]methyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[[[3-(aminomethyl)phenyl]methyl-ethanoyl-amino]methyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[[acetyl-[[3-(aminomethyl)phenyl]methyl]amino]methyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[[acetyl-[[3-(aminomethyl)phenyl]methyl]amino]methyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[[acetyl-[[3-(aminomethyl)phenyl]methyl]amino]methyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[acetyl-[3-(aminomethyl)benzyl]amino]methyl]phenyl]cyclohexanecarboxamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2CCCCC2)CC3=CC=CC(=C3)CN

Isomeric SMILES

CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2CCCCC2)CC3=CC=CC(=C3)CN

InChI

InChI=1S/C24H31N3O2/c1-18(28)27(17-21-7-5-6-20(14-21)15-25)16-19-10-12-23(13-11-19)26-24(29)22-8-3-2-4-9-22/h5-7,10-14,22H,2-4,8-9,15-17,25H2,1H3,(H,26,29)