(2S)-N-(7-azanyl-2-oxidanylidene-heptan-3-yl)-2-[[(2R)-2-azanylpropanoyl]amino]-3-phenyl-propanamide

Systemtic Name: (2S)-N-(7-azanyl-2-oxidanylidene-heptan-3-yl)-2-[[(2R)-2-azanylpropanoyl]amino]-3-phenyl-propanamide Openeye Name: (2S)-N-(1-acetyl-5-amino-pentyl)-2-[[(2R)-2-aminopropanoyl]amino]-3-phenyl-propanamide CAS Name: (2S)-N-(7-amino-2-oxoheptan-3-yl)-2-[[(2R)-2-amino-1-oxopropyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-N-(7-amino-2-oxoheptan-3-yl)-2-[[(2R)-2-aminopropanoyl]amino]-3-phenylpropanamide Traditional Name: (2S)-N-(1-acetyl-5-amino-pentyl)-2-[[(2R)-2-aminopropanoyl]amino]-3-phenyl-propionamide Formula: C19H30N4O3 MolecularWeight: 362.4665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(CCCCN)C(=O)C)N

InChI

InChI=1S/C19H30N4O3/c1-13(21)18(25)23-17(12-15-8-4-3-5-9-15)19(26)22-16(14(2)24)10-6-7-11-20/h3-5,8-9,13,16-17H,6-7,10-12,20-21H2,1-2H3,(H,22,26)(H,23,25)/t13-,16?,17+/m1/s1