N-[[3-(aminomethyl)phenyl]methyl]-3-azanyl-4-(3,5-dimethylmorpholin-4-yl)benzamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-3-azanyl-4-(3,5-dimethylmorpholin-4-yl)benzamide Openeye Name: 3-amino-N-[[3-(aminomethyl)phenyl]methyl]-4-(3,5-dimethylmorpholin-4-yl)benzamide CAS Name: 3-amino-N-[[3-(aminomethyl)phenyl]methyl]-4-(3,5-dimethyl-4-morpholinyl)benzamide IUPAC Name: 3-amino-N-[[3-(aminomethyl)phenyl]methyl]-4-(3,5-dimethylmorpholin-4-yl)benzamide Traditional Name: 3-amino-N-[3-(aminomethyl)benzyl]-4-(3,5-dimethylmorpholino)benzamide Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCC(N1C2=C(C=C(C=C2)C(=O)NCC3=CC=CC(=C3)CN)N)C

Isomeric SMILES

CC1COCC(N1C2=C(C=C(C=C2)C(=O)NCC3=CC=CC(=C3)CN)N)C

InChI

InChI=1S/C21H28N4O2/c1-14-12-27-13-15(2)25(14)20-7-6-18(9-19(20)23)21(26)24-11-17-5-3-4-16(8-17)10-22/h3-9,14-15H,10-13,22-23H2,1-2H3,(H,24,26)