N-(1-azanyl-1-azanylidene-3-oxidanyl-propan-2-yl)-4-octyl-benzamide

Systemtic Name: N-(1-azanyl-1-azanylidene-3-oxidanyl-propan-2-yl)-4-octyl-benzamide Openeye Name: N-[2-amino-1-(hydroxymethyl)-2-imino-ethyl]-4-octyl-benzamide CAS Name: N-(1-amino-3-hydroxy-1-iminopropan-2-yl)-4-octylbenzamide IUPAC Name: N-(1-amino-3-hydroxy-1-iminopropan-2-yl)-4-octylbenzamide Traditional Name: N-(2-amino-2-imino-1-methylol-ethyl)-4-octyl-benzamide Formula: C18H29N3O2 MolecularWeight: 319.44176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)NC(CO)C(=N)N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)NC(CO)C(=N)N

InChI

InChI=1S/C18H29N3O2/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)18(23)21-16(13-22)17(19)20/h9-12,16,22H,2-8,13H2,1H3,(H3,19,20)(H,21,23)