N-[bis(azanyl)methylidene]-3-(4-oxidanylpiperidin-1-yl)carbonyl-5-pyrrol-1-yl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-3-(4-oxidanylpiperidin-1-yl)carbonyl-5-pyrrol-1-yl-benzamide Openeye Name: N-(diaminomethylene)-3-(4-hydroxypiperidine-1-carbonyl)-5-pyrrol-1-yl-benzamide CAS Name: N-(diaminomethylidene)-3-[(4-hydroxy-1-piperidinyl)-oxomethyl]-5-(1-pyrrolyl)benzamide IUPAC Name: N-(diaminomethylidene)-3-(4-hydroxypiperidine-1-carbonyl)-5-pyrrol-1-ylbenzamide Traditional Name: N-(diaminomethylene)-3-(4-hydroxypiperidine-1-carbonyl)-5-pyrrol-1-yl-benzamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)C2=CC(=CC(=C2)C(=O)N=C(N)N)N3C=CC=C3

Isomeric SMILES

C1CN(CCC1O)C(=O)C2=CC(=CC(=C2)C(=O)N=C(N)N)N3C=CC=C3

InChI

InChI=1S/C18H21N5O3/c19-18(20)21-16(25)12-9-13(11-14(10-12)22-5-1-2-6-22)17(26)23-7-3-15(24)4-8-23/h1-2,5-6,9-11,15,24H,3-4,7-8H2,(H4,19,20,21,25)