2-azanyl-3-phenyl-propanamide; 3-phenyl-2-(undec-10-enoylamino)propanoic acid

Systemtic Name: 2-azanyl-3-phenyl-propanamide; 3-phenyl-2-(undec-10-enoylamino)propanoic acid Openeye Name: 2-amino-3-phenyl-propanamide; 3-phenyl-2-(undec-10-enoylamino)propanoic acid CAS Name: 2-amino-3-phenylpropanamide; 2-(1-oxoundec-10-enylamino)-3-phenylpropanoic acid IUPAC Name: 2-amino-3-phenylpropanamide; 3-phenyl-2-(undec-10-enoylamino)propanoic acid Traditional Name: 2-amino-3-phenyl-propionamide; 3-phenyl-2-(undec-10-enoylamino)propionic acid Formula: C29H41N3O4 MolecularWeight: 495.65354

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)O.C1=CC=C(C=C1)CC(C(=O)N)N

Isomeric SMILES

C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)O.C1=CC=C(C=C1)CC(C(=O)N)N

InChI

InChI=1S/C20H29NO3.C9H12N2O/c1-2-3-4-5-6-7-8-12-15-19(22)21-18(20(23)24)16-17-13-10-9-11-14-17;10-8(9(11)12)6-7-4-2-1-3-5-7/h2,9-11,13-14,18H,1,3-8,12,15-16H2,(H,21,22)(H,23,24);1-5,8H,6,10H2,(H2,11,12)