2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-[2-[(4-methoxyphenyl)amino]ethyl]-3-phenyl-propanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-[2-[(4-methoxyphenyl)amino]ethyl]-3-phenyl-propanamide Openeye Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-[2-(4-methoxyanilino)ethyl]-3-phenyl-propanamide CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-N-[2-(4-methoxyanilino)ethyl]-3-phenylpropanamide IUPAC Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-[2-(4-methoxyanilino)ethyl]-3-phenylpropanamide Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-[2-(p-anisidino)ethyl]-3-phenyl-propionamide Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NCCNC(=O)C(CC2=CC=CC=C2)NC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)NCCNC(=O)C(CC2=CC=CC=C2)NC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H28N4O5/c1-33-21-10-7-19(8-11-21)27-13-14-28-25(31)22(15-18-5-3-2-4-6-18)30-26(32)29-20-9-12-23-24(16-20)35-17-34-23/h2-12,16,22,27H,13-15,17H2,1H3,(H,28,31)(H2,29,30,32)