1-(1,3-benzodioxol-5-ylmethyl)-3-[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3S)-1-(3-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3S)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3S)-1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1-[(3S)-5-keto-1-(3-methoxyphenyl)pyrrolidin-3-yl]-3-piperonyl-urea Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)NC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)N2C[C@H](CC2=O)NC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O5/c1-26-16-4-2-3-15(9-16)23-11-14(8-19(23)24)22-20(25)21-10-13-5-6-17-18(7-13)28-12-27-17/h2-7,9,14H,8,10-12H2,1H3,(H2,21,22,25)/t14-/m0/s1