4-[(E)-3-azanyl-2-methyl-3-oxidanylidene-prop-1-enyl]-N-[(2S)-2,6-bis(azanyl)hexanoyl]benzamide

Systemtic Name: 4-[(E)-3-azanyl-2-methyl-3-oxidanylidene-prop-1-enyl]-N-[(2S)-2,6-bis(azanyl)hexanoyl]benzamide Openeye Name: 4-[(E)-3-amino-2-methyl-3-oxo-prop-1-enyl]-N-[(2S)-2,6-diaminohexanoyl]benzamide CAS Name: 4-[(E)-3-amino-2-methyl-3-oxoprop-1-enyl]-N-[(2S)-2,6-diamino-1-oxohexyl]benzamide IUPAC Name: 4-[(E)-3-amino-2-methyl-3-oxoprop-1-enyl]-N-[(2S)-2,6-diaminohexanoyl]benzamide Traditional Name: 4-[(E)-3-amino-3-keto-2-methyl-prop-1-enyl]-N-[(2S)-2,6-diaminohexanoyl]benzamide Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)C(=O)NC(=O)C(CCCCN)N)C(=O)N

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)C(=O)NC(=O)[C@H](CCCCN)N)/C(=O)N

InChI

InChI=1S/C17H24N4O3/c1-11(15(20)22)10-12-5-7-13(8-6-12)16(23)21-17(24)14(19)4-2-3-9-18/h5-8,10,14H,2-4,9,18-19H2,1H3,(H2,20,22)(H,21,23,24)/b11-10+/t14-/m0/s1